Literature DB >> 16815055

Spectral reconstruction methods in fast NMR: reduced dimensionality, random sampling and maximum entropy.

Mehdi Mobli1, Alan S Stern, Jeffrey C Hoch.   

Abstract

The need to reduce data acquisition times of multidimensional NMR experiments has fostered considerable interest in novel data acquisition schemes. A recurring theme is that of reduced dimensionality experiments, in which time evolutions in the indirect dimensions are incremented together, rather than independently. Spectral analysis of such data is carried out using methods such as filtered back-projection, GFT, or parametric signal modeling. By using Maximum Entropy reconstruction of reduced-dimensionality data, we show that the artifacts that arise in reduced dimensionality experiments are intrinsic to the data sampling, and are not, in general, the result of the methods used to compute spectra. Our results illustrate that reduced dimensionality is a special case of non-uniform sampling in the time domain. We show that MaxEnt reconstruction yields more accurate spectra for reduced dimensionality data than back-projection reconstruction and that randomly choosing time increments based on an exponentially weighted distribution is more efficient, with fewer artifacts, than the systematic coupling of time increments used in most reduced dimensionality approaches.

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Year:  2006        PMID: 16815055     DOI: 10.1016/j.jmr.2006.06.007

Source DB:  PubMed          Journal:  J Magn Reson        ISSN: 1090-7807            Impact factor:   2.229


  39 in total

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Review 2.  Radial sampling for fast NMR: Concepts and practices over three decades.

Authors:  Brian E Coggins; Ronald A Venters; Pei Zhou
Journal:  Prog Nucl Magn Reson Spectrosc       Date:  2010-07-30       Impact factor: 9.795

3.  Iterative algorithm of discrete Fourier transform for processing randomly sampled NMR data sets.

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Journal:  J Biomol NMR       Date:  2010-04-07       Impact factor: 2.835

4.  Advances in Nuclear Magnetic Resonance for Drug Discovery.

Authors:  Robert Powers
Journal:  Expert Opin Drug Discov       Date:  2009-10-01       Impact factor: 6.098

5.  Comparison of maximum entropy and filtered back-projection methods to reconstruct rapid-scan EPR images.

Authors:  Mark Tseitlin; Amarjot Dhami; Sandra S Eaton; Gareth R Eaton
Journal:  J Magn Reson       Date:  2006-10-27       Impact factor: 2.229

6.  Randomization improves sparse sampling in multidimensional NMR.

Authors:  Jeffrey C Hoch; Mark W Maciejewski; Blagoje Filipovic
Journal:  J Magn Reson       Date:  2008-05-21       Impact factor: 2.229

7.  Analytical solution to the coupled evolution of multidimensional NMR data.

Authors:  Geoffrey A Mueller
Journal:  J Biomol NMR       Date:  2009-03-24       Impact factor: 2.835

8.  4D non-uniformly sampled HCBCACON and ¹J(NCα)-selective HCBCANCO experiments for the sequential assignment and chemical shift analysis of intrinsically disordered proteins.

Authors:  Jiří Nováček; Noam Y Haba; Jordan H Chill; Lukáš Zídek; Vladimír Sklenář
Journal:  J Biomol NMR       Date:  2012-05-13       Impact factor: 2.835

Review 9.  Magic angle spinning NMR of viruses.

Authors:  Caitlin M Quinn; Manman Lu; Christopher L Suiter; Guangjin Hou; Huilan Zhang; Tatyana Polenova
Journal:  Prog Nucl Magn Reson Spectrosc       Date:  2015-02-16       Impact factor: 9.795

10.  High resolution 4-D spectroscopy with sparse concentric shell sampling and FFT-CLEAN.

Authors:  Brian E Coggins; Pei Zhou
Journal:  J Biomol NMR       Date:  2008-10-14       Impact factor: 2.835

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